N-[[2-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: N-[[2-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[(2-isobutyltetrazol-5-yl)carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[[2-(2-methylpropyl)-5-tetrazolyl]amino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[2-(2-methylpropyl)tetrazol-5-yl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[(2-isobutyltetrazol-5-yl)thiocarbamoyl]-4-propoxy-benzamide Formula: C16H22N6O2S MolecularWeight: 362.44988

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NN(N=N2)CC(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NN(N=N2)CC(C)C

InChI

InChI=1S/C16H22N6O2S/c1-4-9-24-13-7-5-12(6-8-13)14(23)17-16(25)18-15-19-21-22(20-15)10-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H2,17,18,20,23,25)